Information card for entry 7115101

Structure parameters

• Formula: C25 H20 Co2 N6 O6
• Calculated formula: C25 H20 Co2 N6 O6
• Title of publication: Ferromagnetic interactions in the first dicubane-type complex involving cyanate ligand: [Co4(dpk-OH)2(dpk-OMe)2(NCO)4]
• Authors of publication: Barandika, M. Gotzone; Cortés, Roberto; Serna, Zurine; Lezama, Luis; Rojo, Teófilo; Urtiaga, M. Karmele; Arriortua, M. Isabel
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 1
• Pages of publication: 45
• a: 13.0395 ± 0.0013 Å
• b: 12.3033 ± 0.0013 Å
• c: 19.3648 ± 0.0015 Å
• α: 90°
• β: 122.575 ± 0.009°
• γ: 90°
• Cell volume: 2618 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2125
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1352
• Goodness-of-fit parameter for all reflections included in the refinement: 0.799
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No